1-(2-fluorophenyl)-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea

C17H17FN2O — CID 2812537

IUPAC1-(2-fluorophenyl)-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea
SMILESO=C(Nc1ccccc1F)NC1CCCc2ccccc21
InChIInChI=1S/C17H17FN2O/c18-14-9-3-4-10-16(14)20-17(21)19-15-11-5-7-12-6-1-2-8-13(12)15/h1-4,6,8-10,15H,5,7,11H2,(H2,19,20,21)
InChIKeyJAOPFNJJRDGNBZ-UHFFFAOYSA-N
MW284.33 g/mol
LogP4.02
Rot. Bonds2

About 1-(2-fluorophenyl)-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea

1-(2-fluorophenyl)-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea (PubChem CID 2812537) has the molecular formula C17H17FN2O and a molecular weight of 284.33 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea.

Molecular Properties

Compound Name1-(2-fluorophenyl)-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea
PubChem CID2812537
Molecular FormulaC17H17FN2O
Molecular Weight284.33 g/mol
Exact Mass284.13
IUPAC Name1-(2-fluorophenyl)-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea
SMILESO=C(Nc1ccccc1F)NC1CCCc2ccccc21
InChIInChI=1S/C17H17FN2O/c18-14-9-3-4-10-16(14)20-17(21)19-15-11-5-7-12-6-1-2-8-13(12)15/h1-4,6,8-10,15H,5,7,11H2,(H2,19,20,21)
InChIKeyJAOPFNJJRDGNBZ-UHFFFAOYSA-N
XLogP4.02
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.33
LogP ≤ 54.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-Benzyl-3-(1-naphthyl)urea
CID 668231
Urea, N,N''-1,5-naphthalenediylbis[N',N'-dimethyl-
CID 99645
1-(Naphthalen-2-yl)-3-phenylurea
CID 239526
1-Naphthylurea
CID 81387
1-(1-Naphthyl)-3-(P-tolyl)urea
CID 295006
Urea, 1-(1-naphthyl)-3-phenyl-
CID 239525
1-Cyclohexyl-3-naphthalen-1-ylurea
CID 830951
1-(4-Fluorobenzyl)-3-phenylurea
CID 896691
3-(1-Benzylpiperidin-4-yl)-1-phenylurea
CID 4064342
1-(Naphthalen-1-yl)-3-(m-tolyl)urea
CID 4196307
1,1-Dibenzyl-3-(M-tolyl)urea
CID 3404984
1,3-Bis(1-naphthyl)urea
CID 69087

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea?
The IUPAC name of 1-(2-fluorophenyl)-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea (CID 2812537) is 1-(2-fluorophenyl)-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea.
What is the SMILES notation for 1-(2-fluorophenyl)-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea?
The canonical SMILES for 1-(2-fluorophenyl)-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea is O=C(Nc1ccccc1F)NC1CCCc2ccccc21.
What is the InChIKey of 1-(2-fluorophenyl)-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea?
The InChIKey is JAOPFNJJRDGNBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O/c18-14-9-3-4-10-16(14)20-17(21)19-15-11-5-7-12-6-1-2-8-13(12)15/h1-4,6,8-10,15H,5,7,11H2,(H2,19,20,21).
What are the key properties of 1-(2-fluorophenyl)-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea?
1-(2-fluorophenyl)-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea has a molecular weight of 284.33 g/mol, XLogP of 4.02, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea is sourced from PubChem (CID 2812537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).